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CAS 1103234-56-5 2,6-Difluoro-3-(propylsulfonaMido)benzoic acid molecular structure lightbox
CAS RN: 1103234-56-5

2,6-Difluoro-3-(propylsulfonaMido)benzoic acid

Product Availability

Choose a grade to view its available package options.

5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260330 100g In stock Shanghai, Tianjin Inquiry
Batchno.20260320 1g In stock Shanghai, Tianjin Inquiry
Batchno.20250512 25g In stock Shanghai Inquiry
Batchno.20250509 500g Out of stock Inquiry
Batchno.20250928 5g In stock Shanghai, Tianjin Inquiry
  • Product code: SSC-011425
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 10g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1103234-56-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ＞97% 0 Out of Stock Beijing Inquiry

1103234-56-5 / 2,6-difluoro-3-(propylsulfonylamino)benzoic acid

EC 700-740-0 | 2,6-Difluoro-3-((propylsulfonyl)amino)benzoic acid | 2,6-difluoro-3-[(propylsulfonyl)amino]Benzoic acid

Standard CAS: 1103234-56-5 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1103234-56-5
Multi CAS
No
Molecular Formula
C10H11F2NO4S
Molecular Weight
279.260000
Exact Mass
279.037685
SMILES
CCCS(=O)(=O)NC1=C(C(=C(C=C1)F)C(=O)O)F
InChI
InChI=1S/C10H11F2NO4S/c1-2-5-18(16,17)13-7-4-3-6(11)8(9(7)12)10(14)15/h3-4,13H,2,5H2,1H3,(H,14,15)
InChIKey
RTAWCKGXCGSFJI-UHFFFAOYSA-N
Synonyms
EC 700-740-0 2,6-Difluoro-3-((propylsulfonyl)amino)benzoic acid 2,6-difluoro-3-[(propylsulfonyl)amino]Benzoic acid RefChem:83219 700-740-0

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
2
Molar refractivity
61.02
TPSA
83.47

LogP / Solubility

WLOGP
1.81
MLOGP
1.61
XLogP3
1.5
Consensus LogP
1.64
Log S (ESOL)
-2.63
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.16
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.58
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.14

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5

Safety & Transport

GHS Hazard Statements
Not Classified Reported as not meeting GHS hazard criteria by 3 of 3 companies. For more detailed information, please visit ECHA C&L website.

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